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3,17-Bis[(isopropyl-dimethylsilyl)oxy]estra-1,3,5(10)-triene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3,17-Bis[(isopropyl-dimethylsilyl)oxy]estra-1,3,5(10)-triene
SpectraBase Compound ID CmpQyuTNMfu
InChI InChI=1S/C28H48O2Si2/c1-19(2)31(6,7)29-22-11-13-23-21(18-22)10-12-25-24(23)16-17-28(5)26(25)14-15-27(28)30-32(8,9)20(3)4/h11,13,18-20,24-27H,10,12,14-17H2,1-9H3
InChIKey IBPSPDGFZXWLBL-UHFFFAOYSA-N
Mol Weight 472.9 g/mol
Molecular Formula C28H48O2Si2
Exact Mass 472.319284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5uLRFgF3js4
Name 3,17-bis[(Isopropyl-dimethylsilyl)oxy]estra-1,3,5(10)-triene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.319283854 u
Formula C28H48O2Si2
InChI InChI=1S/C28H48O2Si2/c1-19(2)31(6,7)29-22-11-13-23-21(18-22)10-12-25-24(23)16-17-28(5)26(25)14-15-27(28)30-32(8,9)20(3)4/h11,13,18-20,24-27H,10,12,14-17H2,1-9H3
InChIKey IBPSPDGFZXWLBL-UHFFFAOYSA-N
Molecular Weight 472.860 g/mol
SMILES C12(C(C3CCC=4C(C3CC2)=CC=C(O[Si](C(C)C)(C)C)C4)CCC1O[Si](C(C)C)(C)C)C